A3882/0165039
TL;DR: A3882/0165039 (CAS 728037-29-4) is a chemical compound with molecular formula C30H21FN4O2 and molecular weight 488.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-fluorophenyl)-2',5-dioxo-1'-prop-2-ynyl-2-pyrrol-1-ylspiro[7,8-dihydro-6H-quinoline-4,3'-indole]-3-carbonitrile
Also Known As: A3882/0165039, 1'-(4-fluorophenyl)-2,5'-dioxo-1-(prop-2-yn-1-yl)-2'-(1H-pyrrol-1-yl)-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile, 1-(4-fluorophenyl)-2',5-dioxo-1'-prop-2-ynyl-2-pyrrol-1-ylspiro[7,8-dihydro-6H-quinoline-4,3'-indole]-3-carbonitrile, 1'-(4-FLUOROPHENYL)-2,5'-DIOXO-1-PROP-2-YN-1-YL-2'-(1H-PYRROL-1-YL)-1,2,5',6',7',8'-HEXAHYDRO-1'H-SPIRO[INDOLE-3,4'-QUINOLINE]-3'-CARBONITRILE, 1-(4-fluorophenyl)-5,12-dioxo-11-prop-2-ynyl-2-pyrrolylspiro[1,4,6,7,8-pentahy droquinoline-4,3'-indoline]-3-carbonitrile
| Molecular Formula | C30H21FN4O2 |
|---|---|
| Molecular Weight | 488.16 g/mol |
| LogP | 4.76448 |
| Topological Polar Surface Area | 69.34 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 488.16486 |
| Heavy Atoms | 37 |
| Complexity | 1602.0918 |
Chemical Identifiers
| CAS Number | 728037-29-4 |
|---|---|
| SMILES | C#CCN1C2=CC=CC=C2C3(C1=O)C(=C(N(C4=C3C(=O)CCC4)C5=CC=C(C=C5)F)N6C=CC=C6)C#N |
Product Overview
A3882/0165039 (CAS 728037-29-4), with molecular formula C30H21FN4O2 and molecular weight 488.16 g/mol. IUPAC: 1-(4-fluorophenyl)-2',5-dioxo-1'-prop-2-ynyl-2-pyrrol-1-ylspiro[7,8-dihydro-6H-quinoline-4,3'-indole]-3-carbonitrile.
Chemical Property Profile of A3882/0165039
Property Insights of A3882/0165039
The XLogP value of 4.76448 indicates that A3882/0165039 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.34 Ų falls within the moderate polarity range, balancing permeability and solubility for A3882/0165039. Following Lipinski's Rule of Five, A3882/0165039 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A3882/0165039?
The CAS number of A3882/0165039 is 728037-29-4.
What is the molecular formula of A3882/0165039?
The molecular formula of A3882/0165039 is C30H21FN4O2.
What is the molecular weight of A3882/0165039?
The molecular weight of A3882/0165039 is 488.16 g/mol.
Where can I buy A3882/0165039?
You can request a quote for A3882/0165039 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3882/0165039?
Yes, KEHONG BIO provides custom synthesis services for A3882/0165039 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.